(Bromoethynyl)benzene - CAS 932-87-6

Name: (Bromoethynyl)benzene
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB040838
Product Name:	(Bromoethynyl)benzene
CAS:	932-87-6
Synonyms:	2-bromoethynylbenzene

Technical Data

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Computed Properties

IUPAC Name:	2-bromoethynylbenzene
Description:	(Bromoethynyl)benzene (CAS# 932-87-6) is a useful research chemical.
Molecular Weight:	181.03
Molecular Formula:	C8H5Br
Canonical SMILES:	C1=CC=C(C=C1)C#CBr
InChI:	InChI=1S/C8H5Br/c9-7-6-8-4-2-1-3-5-8/h1-5H
InChI Key:	BPVHWNVBBDHIQU-UHFFFAOYSA-N
Boiling Point:	217.4 °C at 760 mmHg
Density:	1.51 g/cm³
Appearance:	Dark yellow clear liquid
Storage:	Sealed in dry, Store in freezer, under -20 °C
MDL:	MFCD00015715
LogP:	2.39050

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Related Functional Groups

Alkynes

[137648-47-6]C11H13ISi
Silane, [(2-iodophenyl)ethynyl]trimethyl-
[5390-04-5]C5H8O
4-Pentyn-1-ol
[1066-54-2]C5H10Si
Ethynyltrimethylsilane
[2230803-78-6]C7H8INO
1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carbonitrile
[66800-19-9]C13H22O2
5-Octyn-1-ol tetrahydropyranol ether
[1777-03-3]C8H16Si
(Triethylsilyl)acetylene

Halides

[134005-20-2]C4H6I2
(Z)-1,3-Diiodo-2-butene
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole
[932890-93-2]C16H17Cl2NO2
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[4860-03-1]C16H33Cl
1-Chlorohexadecane
[111-85-3]C8H17Cl
1-Chlorooctane

GHS Hazard Statement:	H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
Precautionary Statement:	P261, P271, P280, P304+P312, P304+P340, P305+P351+P338, P310, and P312
Signal Word:	Danger

Publication Number	Title	Priority Date
CN-113429302-A	Naphthofluorene derivative, luminescent material, luminescent element and consumer product	20210827
CN-113354691-A	Synthetic method of ferrocene derivative luminescent material	20210604
CN-113045586-A	Synthetic method of benzoxazole alkane derivative	20210326
CN-111620808-A	2-aldehyde indole compound and preparation method thereof	20200629
CN-111592607-A	Application of covalent organic framework material loaded with rhodium catalyst in alkyne polymerization	20200522

PMID	Publication Date	Title	Journal
21388124	20110406	Linear- and angular-shaped naphthodithiophenes: selective synthesis, properties, and application to organic field-effect transistors	Journal of the American Chemical Society
15750643	20050321	Effect of cyclodextrin complexation in bromine addition to unsymmetrical olefins: evidence for participation of cyclodextrin hydroxyl groups	Organic & biomolecular chemistry

Complexity:	131
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.95746
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	179.95746
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6